Cas no 936907-96-9 (1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone)
936907-96-9 structure
Product Name:1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone
CAS No:936907-96-9
MF:C5H7N3O
MW:125.128580331802
CID:5759637
PubChem ID:82376272
Update Time:2023-11-15
1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL19919554
- 1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone
- EN300-7092368
- 936907-96-9
- 1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one
- Ethanone, 1-(3-methyl-1H-1,2,4-triazol-5-yl)-
-
- Inchi： 1S/C5H7N3O/c1-3(9)5-6-4(2)7-8-5/h1-2H3,(H,6,7,8)
- InChI Key： HRSUGPPVLWAVET-UHFFFAOYSA-N
- SMILES： O=C(C)C1=NNC(C)=N1
Computed Properties
- Exact Mass: 125.058911855g/mol
- Monoisotopic Mass: 125.058911855g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 125
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 58.6?2
Experimental Properties
- Density: 1.226±0.06 g/cm3(Predicted)
- Boiling Point: 313.5±25.0 °C(Predicted)
- pka: 8.32±0.40(Predicted)
1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| 1PlusChem | 1P028I01-50mg |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 50mg |
$382.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-100mg |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 100mg |
$557.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-250mg |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 250mg |
$769.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-500mg |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 500mg |
$1177.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-1g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 1g |
$1492.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-2.5g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 2.5g |
$2866.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-5g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 5g |
$4209.00 | 2024-04-20 | |
| 1PlusChem | 1P028I01-10g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 10g |
$6210.00 | 2024-04-20 | |
| Enamine | EN300-7092368-0.05g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 0.05g |
$268.0 | 2023-05-26 | |
| Enamine | EN300-7092368-0.1g |
1-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-one |
936907-96-9 | 95% | 0.1g |
$400.0 | 2023-05-26 |
1-(5-Methyl-1H-1,2,4-triazol-3-yl)ethanone Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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